| SpectraBase Spectrum ID |
DDMuivmiQWf |
| Name |
[2'-Methyl-2'-(prop-2''-enyl)-cyclohexylidene]-propanedinitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
200.131348523 u |
| Formula |
C13H16N2 |
| InChI |
InChI=1S/C13H16N2/c1-3-7-13(2)8-5-4-6-12(13)11(9-14)10-15/h3H,1,4-8H2,2H3 |
| InChIKey |
PDERLJFWNMECRE-UHFFFAOYSA-N |
| Molecular Weight |
200.285 g/mol |
| SMILES |
C(#N)C(=C1C(CC=C)(C)CCCC1)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.882163 |
![[2'-Methyl-2'-(prop-2''-enyl)-cyclohexylidene]-propanedinitrile](/api/spectrum/DDMuivmiQWf/structure.png?h=300&w=458 "[2'-Methyl-2'-(prop-2''-enyl)-cyclohexylidene]-propanedinitrile")
